| SpectraBase Spectrum ID |
L67EyTwBGcp |
| Name |
2-(3,4-Dimethoxy-phenyl)-5,7-dimethyl-1,3-diaza-bicyclo[3.3.1]nonan-6-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.194342702 u |
| Formula |
C17H26N2O3 |
| InChI |
InChI=1S/C17H26N2O3/c1-11-8-19-10-17(2,15(11)20)9-18-16(19)12-5-6-13(21-3)14(7-12)22-4/h5-7,11,15-16,18,20H,8-10H2,1-4H3/t11?,15?,16-,17-/m1/s1 |
| InChIKey |
DUDNGERFGALUCI-ICLYLHAVSA-N |
| Molecular Weight |
306.406 g/mol |
| SMILES |
COC=1C=CC([C@]2(N3C[C@](CN2)(C)C(C(C3)C)O)[H])=CC1OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961184 |
![2-(3,4-Dimethoxy-phenyl)-5,7-dimethyl-1,3-diaza-bicyclo[3.3.1]nonan-6-ol](/api/spectrum/L67EyTwBGcp/structure.png?h=300&w=458 "2-(3,4-Dimethoxy-phenyl)-5,7-dimethyl-1,3-diaza-bicyclo[3.3.1]nonan-6-ol")
